| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 21 | Yes |
Popular Name: 2-[2-[(1S)-1-(methylamino)ethyl]phenyl]sulfanyl-6-propyl-1H-pyrimidin-4-one 2-[2-[(1S)-1-(methylamino)ethyl]…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.50 | 7.12 | -45.65 | 3 | 4 | 1 | 62 | 304.439 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 3.98 | -48.01 | 1 | 4 | -1 | 61 | 302.423 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 5.21 | -50.48 | 2 | 4 | 0 | 65 | 303.431 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.50 | 6.52 | -46.49 | 3 | 4 | 1 | 62 | 304.439 | 6 | ↓ |
